N-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide

C20H19ClN2O3 — CID 24981315

IUPACN-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide
SMILESCc1noc(C)c1COc1ccccc1C(=O)NCc1ccccc1Cl
InChIInChI=1S/C20H19ClN2O3/c1-13-17(14(2)26-23-13)12-25-19-10-6-4-8-16(19)20(24)22-11-15-7-3-5-9-18(15)21/h3-10H,11-12H2,1-2H3,(H,22,24)
InChIKeyPHRIBMFJNBFJDL-UHFFFAOYSA-N
MW370.84 g/mol
LogP4.45
Rot. Bonds6

About N-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide

N-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide (PubChem CID 24981315) has the molecular formula C20H19ClN2O3 and a molecular weight of 370.84 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide
PubChem CID24981315
Molecular FormulaC20H19ClN2O3
Molecular Weight370.84 g/mol
Exact Mass370.11
IUPAC NameN-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide
SMILESCc1noc(C)c1COc1ccccc1C(=O)NCc1ccccc1Cl
InChIInChI=1S/C20H19ClN2O3/c1-13-17(14(2)26-23-13)12-25-19-10-6-4-8-16(19)20(24)22-11-15-7-3-5-9-18(15)21/h3-10H,11-12H2,1-2H3,(H,22,24)
InChIKeyPHRIBMFJNBFJDL-UHFFFAOYSA-N
XLogP4.45
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.84
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide?
The IUPAC name of N-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide (CID 24981315) is N-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide is Cc1noc(C)c1COc1ccccc1C(=O)NCc1ccccc1Cl.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide?
The InChIKey is PHRIBMFJNBFJDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19ClN2O3/c1-13-17(14(2)26-23-13)12-25-19-10-6-4-8-16(19)20(24)22-11-15-7-3-5-9-18(15)21/h3-10H,11-12H2,1-2H3,(H,22,24).
What are the key properties of N-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide?
N-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide has a molecular weight of 370.84 g/mol, XLogP of 4.45, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide is sourced from PubChem (CID 24981315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).